2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G856-1297 |
| Compound Name: | 2-[(2-oxo-2-phenylethyl)sulfanyl]-3-[3-(trifluoromethyl)phenyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 479.48 |
| Molecular Formula: | C25 H16 F3 N3 O2 S |
| Smiles: | C(C(c1ccccc1)=O)SC1=Nc2c3ccccc3[nH]c2C(N1c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9267 |
| logD: | 4.9267 |
| logSw: | -5.1825 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.365 |
| InChI Key: | FYHCDCPOXZVTQP-UHFFFAOYSA-N |